2-(3-nitrophenyl)-N-phenethyl-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 2-(3-nitrophenyl)-N-phenethyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: 2-(3-nitrophenyl)-N-phenethyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: 2-(3-nitrophenyl)-N-phenethyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: 2-(3-nitrophenyl)-N-phenethyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: 2-(3-nitrophenyl)-N-phenethyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C22H18N4O3S MolecularWeight: 418.46832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=CC(=NN2C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C22H18N4O3S/c27-22(23-12-11-16-6-2-1-3-7-16)20-15-19(21-10-5-13-30-21)24-25(20)17-8-4-9-18(14-17)26(28)29/h1-10,13-15H,11-12H2,(H,23,27)